1-[[4-[4-(6-nitropyridin-3-yl)piperazin-1-yl]carbonylphenyl]methyl]pyrrolidine-2,5-dione

Systemtic Name: 1-[[4-[4-(6-nitropyridin-3-yl)piperazin-1-yl]carbonylphenyl]methyl]pyrrolidine-2,5-dione Openeye Name: 1-[[4-[4-(6-nitro-3-pyridyl)piperazine-1-carbonyl]phenyl]methyl]pyrrolidine-2,5-dione CAS Name: 1-[[4-[[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-oxomethyl]phenyl]methyl]pyrrolidine-2,5-dione IUPAC Name: 1-[[4-[4-(6-nitropyridin-3-yl)piperazine-1-carbonyl]phenyl]methyl]pyrrolidine-2,5-dione Traditional Name: 1-[4-[4-(6-nitro-3-pyridyl)piperazine-1-carbonyl]benzyl]pyrrolidine-2,5-quinone Formula: C21H21N5O5 MolecularWeight: 423.42194

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1=O)CC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1=O)CC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O5/c27-19-7-8-20(28)25(19)14-15-1-3-16(4-2-15)21(29)24-11-9-23(10-12-24)17-5-6-18(22-13-17)26(30)31/h1-6,13H,7-12,14H2